Geometry & MOs

Info

ID:	201038
PubChem CID:	79479510
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	294.00039
ΔH_f, kcal/mol:	-86.05
Dipole, Da:	5.14
IP(EA), eV:	-8.83(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromophenyl)methyl]-4-methyl-1,3-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

C1COC2=CC=CC(=C2OC1)CNCC3(CC3)CO

DOS

IR

Vibrations